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5-[6-(2,3-dihydroxy-4-pentylphenyl)hexyl]-5'-methyl-2,2'-bipyridine
SpectraBase Compound ID CKjUA6X2W2n
InChI InChI=1S/C28H36N2O2/c1-3-4-7-11-23-15-16-24(28(32)27(23)31)12-9-6-5-8-10-22-14-18-26(30-20-22)25-17-13-21(2)19-29-25/h13-20,31-32H,3-12H2,1-2H3
InChIKey SEWQNJZMJHHUKM-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C28H36N2O2
Exact Mass 432.277678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87bwxSk2hmZ
Name 5-[6-(2,3-dihydroxy-4-pentylphenyl)hexyl]-5'-methyl-2,2'-bipyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36N2O2
InChI InChI=1S/C28H36N2O2/c1-3-4-7-11-23-15-16-24(28(32)27(23)31)12-9-6-5-8-10-22-14-18-26(30-20-22)25-17-13-21(2)19-29-25/h13-20,31-32H,3-12H2,1-2H3
InChIKey SEWQNJZMJHHUKM-UHFFFAOYSA-N
Molecular Weight 432.608 g/mol
SMILES Oc1c(c(ccc1CCCCC)CCCCCCc1cnc(-c2ncc(cc2)C)cc1)O
SPLASH splash10-001i-0500900000-708d5506238ab98aedb1
Source of Spectrum SO-0-960-13
Synonyms 3-{6-[6-(5-methylpyridin-2-yl)pyridin-3-yl]hexyl}-6-pentylbenzene-1,2-diol
Wiley ID 874735